data_A1I0M
# 
_chem_comp.id                                    A1I0M 
_chem_comp.name                                  "dolichol-phosphate (n=4)" 
_chem_comp.type                                  non-polymer 
_chem_comp.pdbx_type                             HETAIN 
_chem_comp.formula                               "C41 H71 O4 P" 
_chem_comp.mon_nstd_parent_comp_id               ? 
_chem_comp.pdbx_synonyms                         "[(3S,6E,10Z,14Z,18Z,22Z,26Z,30Z)-3,7,11,15,19,23,27,31-octamethyltritriaconta-6,10,14,18,22,26,30-heptaenyl] dihydrogen phosphate" 
_chem_comp.pdbx_formal_charge                    0 
_chem_comp.pdbx_initial_date                     2025-01-30 
_chem_comp.pdbx_modified_date                    2025-12-19 
_chem_comp.pdbx_ambiguous_flag                   N 
_chem_comp.pdbx_release_status                   REL 
_chem_comp.pdbx_replaced_by                      ? 
_chem_comp.pdbx_replaces                         ? 
_chem_comp.formula_weight                        658.974 
_chem_comp.one_letter_code                       ? 
_chem_comp.three_letter_code                     A1I0M 
_chem_comp.pdbx_model_coordinates_details        ? 
_chem_comp.pdbx_model_coordinates_missing_flag   N 
_chem_comp.pdbx_ideal_coordinates_details        Corina 
_chem_comp.pdbx_ideal_coordinates_missing_flag   N 
_chem_comp.pdbx_model_coordinates_db_code        9I5L 
_chem_comp.pdbx_subcomponent_list                ? 
_chem_comp.pdbx_processing_site                  PDBE 
_chem_comp.pdbx_pcm                              ? 
# 
loop_
_chem_comp_atom.comp_id 
_chem_comp_atom.atom_id 
_chem_comp_atom.alt_atom_id 
_chem_comp_atom.type_symbol 
_chem_comp_atom.charge 
_chem_comp_atom.pdbx_align 
_chem_comp_atom.pdbx_aromatic_flag 
_chem_comp_atom.pdbx_leaving_atom_flag 
_chem_comp_atom.pdbx_stereo_config 
_chem_comp_atom.pdbx_n_terminal_atom_flag 
_chem_comp_atom.pdbx_backbone_atom_flag 
_chem_comp_atom.pdbx_c_terminal_atom_flag 
_chem_comp_atom.model_Cartn_x 
_chem_comp_atom.model_Cartn_y 
_chem_comp_atom.model_Cartn_z 
_chem_comp_atom.pdbx_model_Cartn_x_ideal 
_chem_comp_atom.pdbx_model_Cartn_y_ideal 
_chem_comp_atom.pdbx_model_Cartn_z_ideal 
_chem_comp_atom.pdbx_component_atom_id 
_chem_comp_atom.pdbx_component_comp_id 
_chem_comp_atom.pdbx_ordinal 
A1I0M C6  C1  C 0 1 N N N N N N 109.566 113.668 96.538  5.314  2.901  0.885  C6  A1I0M 1   
A1I0M C4  C2  C 0 1 N N N N N N 106.264 113.350 95.669  7.561  1.202  -0.104 C4  A1I0M 2   
A1I0M C3  C3  C 0 1 N N S N N N 107.499 112.448 95.610  6.257  0.627  0.452  C3  A1I0M 3   
A1I0M C2  C4  C 0 1 N N N N N N 107.044 110.987 95.626  5.983  -0.733 -0.193 C2  A1I0M 4   
A1I0M C1  C5  C 0 1 N N N N N N 106.352 110.550 94.327  7.073  -1.723 0.224  C1  A1I0M 5   
A1I0M C8  C6  C 0 1 N N N N N N 109.876 115.843 95.401  3.407  4.277  1.540  C8  A1I0M 6   
A1I0M C12 C7  C 0 1 N N N N N N 110.342 119.408 93.795  -0.015 5.716  0.695  C12 A1I0M 7   
A1I0M C10 C8  C 0 1 N N N N N N 109.511 117.291 95.061  2.369  5.332  1.257  C10 A1I0M 8   
A1I0M C13 C9  C 0 1 N N N N N N 111.058 120.007 92.818  -0.622 5.742  -0.465 C13 A1I0M 9   
A1I0M C14 C10 C 0 1 N N N N N N 110.885 121.486 92.535  -1.770 6.692  -0.694 C14 A1I0M 10  
A1I0M C16 C11 C 0 1 N N N N N N 113.522 119.359 92.451  -1.033 3.558  -1.565 C16 A1I0M 11  
A1I0M C17 C12 C 0 1 N N N N N N 114.432 119.934 91.344  -0.584 2.639  -2.671 C17 A1I0M 12  
A1I0M C19 C13 C 0 1 N N N N N N 116.684 120.357 90.402  0.304  0.517  -3.491 C19 A1I0M 13  
A1I0M C20 C14 C 0 1 N N N N N N 116.397 119.124 92.675  0.093  1.051  -0.945 C20 A1I0M 14  
A1I0M C21 C15 C 0 1 N N N N N N 117.150 120.148 93.577  -1.140 0.273  -0.478 C21 A1I0M 15  
A1I0M C22 C16 C 0 1 N N N N N N 116.406 120.329 94.894  -0.960 -0.137 0.961  C22 A1I0M 16  
A1I0M C23 C17 C 0 1 N N N N N N 116.758 119.579 95.933  -1.788 0.301  1.876  C23 A1I0M 17  
A1I0M C24 C18 C 0 1 N N N N N N 116.034 119.726 97.257  -1.667 -0.184 3.297  C24 A1I0M 18  
A1I0M C26 C19 C 0 1 N N N N N N 119.154 119.097 96.592  -4.153 0.542  1.170  C26 A1I0M 19  
A1I0M C28 C20 C 0 1 N N N N N N 120.680 118.101 98.285  -5.756 1.509  -0.397 C28 A1I0M 20  
A1I0M C29 C21 C 0 1 N N N N N N 120.971 117.257 99.521  -6.935 2.392  -0.718 C29 A1I0M 21  
A1I0M C30 C22 C 0 1 N N N N N N 121.820 118.805 97.554  -5.187 0.599  -1.455 C30 A1I0M 22  
A1I0M C31 C23 C 0 1 N N N N N N 122.729 117.904 96.664  -5.978 -0.710 -1.482 C31 A1I0M 23  
A1I0M C32 C24 C 0 1 N N N N N N 124.023 118.584 96.159  -5.408 -1.620 -2.539 C32 A1I0M 24  
A1I0M C33 C25 C 0 1 N N N N N N 124.948 119.226 96.907  -4.913 -2.785 -2.204 C33 A1I0M 25  
A1I0M C35 C26 C 0 1 N N N N N N 124.883 119.339 98.455  -4.767 -3.151 -0.749 C35 A1I0M 26  
A1I0M C34 C27 C 0 1 N N N N N N 126.159 119.847 96.212  -4.489 -3.760 -3.272 C34 A1I0M 27  
A1I0M C37 C28 C 0 1 N N N N N N 125.785 120.353 100.584 -5.845 -4.319 1.155  C37 A1I0M 28  
A1I0M C11 C29 C 0 1 N N N N N N 110.531 117.900 94.071  1.023  4.661  0.979  C11 A1I0M 29  
A1I0M C15 C30 C 0 1 N N N N N N 112.045 119.162 91.992  -0.173 4.823  -1.572 C15 A1I0M 30  
A1I0M C18 C31 C 0 1 N N N N N N 115.752 119.815 91.470  -0.088 1.461  -2.384 C18 A1I0M 31  
A1I0M C25 C32 C 0 1 N N N N N N 117.936 118.595 95.790  -2.862 1.291  1.507  C25 A1I0M 32  
A1I0M C27 C33 C 0 1 N N N N N N 119.421 118.239 97.845  -5.227 1.532  0.801  C27 A1I0M 33  
A1I0M C36 C34 C 0 1 N N N N N N 125.845 120.378 99.048  -5.991 -3.953 -0.300 C36 A1I0M 34  
A1I0M C38 C35 C 0 1 N N N N N N 124.951 121.144 101.238 -6.715 -3.880 2.031  C38 A1I0M 35  
A1I0M C39 C36 C 0 1 N N N N N N 124.905 121.102 102.760 -6.662 -4.370 3.455  C39 A1I0M 36  
A1I0M C40 C37 C 0 1 N N N N N N 124.036 122.084 100.494 -7.767 -2.885 1.614  C40 A1I0M 37  
A1I0M C41 C38 C 0 1 N N N N N N 123.829 123.403 101.208 -9.056 -3.627 1.255  C41 A1I0M 38  
A1I0M C5  C39 C 0 1 N N N N N N 108.403 112.696 96.813  5.103  1.582  0.138  C5  A1I0M 39  
A1I0M C7  C40 C 0 1 N N N N N N 109.143 115.114 96.231  4.178  3.841  0.575  C7  A1I0M 40  
A1I0M C9  C41 C 0 1 N N N N N N 111.117 115.232 94.763  3.559  3.724  2.934  C9  A1I0M 41  
A1I0M O1  O1  O 0 1 N N N N N N 107.094 109.511 93.752  6.818  -2.994 -0.379 O1  A1I0M 42  
A1I0M O2  O2  O 0 1 N N N N N N 105.642 108.232 92.015  7.109  -5.559 -0.873 O2  A1I0M 43  
A1I0M O3  O3  O 0 1 N N N N N N 108.052 108.373 91.624  9.215  -3.988 -0.795 O3  A1I0M 44  
A1I0M O4  O4  O 0 1 N N N N N N 106.663 110.386 91.348  7.909  -4.539 1.293  O4  A1I0M 45  
A1I0M P1  P1  P 0 1 N N N N N N 106.856 109.127 92.151  7.766  -4.276 -0.157 P1  A1I0M 46  
A1I0M H1  H1  H 0 1 N N N N N N 110.133 113.287 95.675  5.346  2.710  1.957  H1  A1I0M 47  
A1I0M H2  H2  H 0 1 N N N N N N 110.216 113.683 97.426  6.255  3.351  0.568  H2  A1I0M 48  
A1I0M H3  H3  H 0 1 N N N N N N 106.578 114.404 95.658  8.383  0.522  0.120  H3  A1I0M 49  
A1I0M H4  H4  H 0 1 N N N N N N 105.622 113.150 94.798  7.473  1.324  -1.183 H4  A1I0M 50  
A1I0M H5  H5  H 0 1 N N N N N N 105.704 113.144 96.593  7.755  2.171  0.356  H5  A1I0M 51  
A1I0M H6  H6  H 0 1 N N N N N N 108.056 112.649 94.683  6.344  0.506  1.532  H6  A1I0M 52  
A1I0M H7  H7  H 0 1 N N N N N N 106.339 110.850 96.460  5.012  -1.102 0.136  H7  A1I0M 53  
A1I0M H8  H8  H 0 1 N N N N N N 107.926 110.349 95.783  5.984  -0.627 -1.278 H8  A1I0M 54  
A1I0M H9  H9  H 0 1 N N N N N N 106.302 111.399 93.630  8.044  -1.354 -0.104 H9  A1I0M 55  
A1I0M H10 H10 H 0 1 N N N N N N 105.334 110.199 94.550  7.072  -1.829 1.309  H10 A1I0M 56  
A1I0M H11 H11 H 0 1 N N N N N N 109.640 119.982 94.381  -0.259 6.450  1.449  H11 A1I0M 57  
A1I0M H12 H12 H 0 1 N N N N N N 109.506 117.888 95.985  2.275  5.990  2.120  H12 A1I0M 58  
A1I0M H13 H13 H 0 1 N N N N N N 108.510 117.312 94.605  2.671  5.915  0.387  H13 A1I0M 59  
A1I0M H14 H14 H 0 1 N N N N N N 110.141 121.908 93.227  -1.387 7.639  -1.077 H14 A1I0M 60  
A1I0M H15 H15 H 0 1 N N N N N N 111.847 122.001 92.673  -2.461 6.260  -1.418 H15 A1I0M 61  
A1I0M H16 H16 H 0 1 N N N N N N 110.541 121.623 91.499  -2.291 6.866  0.248  H16 A1I0M 62  
A1I0M H17 H17 H 0 1 N N N N N N 113.924 118.384 92.763  -2.078 3.828  -1.718 H17 A1I0M 63  
A1I0M H18 H18 H 0 1 N N N N N N 113.533 120.050 93.307  -0.926 3.051  -0.605 H18 A1I0M 64  
A1I0M H19 H19 H 0 1 N N N N N N 114.005 120.425 90.482  -0.672 2.951  -3.701 H19 A1I0M 65  
A1I0M H20 H20 H 0 1 N N N N N N 117.727 120.161 90.691  1.345  0.688  -3.763 H20 A1I0M 66  
A1I0M H21 H21 H 0 1 N N N N N N 116.470 119.862 89.443  0.181  -0.511 -3.152 H21 A1I0M 67  
A1I0M H22 H22 H 0 1 N N N N N N 116.531 121.441 90.298  -0.332 0.693  -4.359 H22 A1I0M 68  
A1I0M H23 H23 H 0 1 N N N N N N 115.612 118.632 93.269  0.217  1.939  -0.326 H23 A1I0M 69  
A1I0M H24 H24 H 0 1 N N N N N N 117.112 118.369 92.315  0.976  0.419  -0.855 H24 A1I0M 70  
A1I0M H25 H25 H 0 1 N N N N N N 118.165 119.777 93.780  -2.023 0.905  -0.568 H25 A1I0M 71  
A1I0M H26 H26 H 0 1 N N N N N N 117.211 121.116 93.057  -1.265 -0.615 -1.097 H26 A1I0M 72  
A1I0M H27 H27 H 0 1 N N N N N N 115.609 121.052 94.981  -0.148 -0.794 1.237  H27 A1I0M 73  
A1I0M H28 H28 H 0 1 N N N N N N 116.463 119.027 97.990  -0.995 0.473  3.850  H28 A1I0M 74  
A1I0M H29 H29 H 0 1 N N N N N N 116.147 120.757 97.624  -2.649 -0.179 3.768  H29 A1I0M 75  
A1I0M H30 H30 H 0 1 N N N N N N 114.966 119.501 97.118  -1.267 -1.198 3.302  H30 A1I0M 76  
A1I0M H31 H31 H 0 1 N N N N N N 120.042 119.064 95.944  -3.974 -0.130 0.330  H31 A1I0M 77  
A1I0M H32 H32 H 0 1 N N N N N N 118.968 120.135 96.906  -4.474 -0.037 2.036  H32 A1I0M 78  
A1I0M H33 H33 H 0 1 N N N N N N 120.032 116.833 99.906  -7.859 1.858  -0.498 H33 A1I0M 79  
A1I0M H34 H34 H 0 1 N N N N N N 121.659 116.441 99.254  -6.886 3.297  -0.113 H34 A1I0M 80  
A1I0M H35 H35 H 0 1 N N N N N N 121.433 117.888 100.295 -6.912 2.658  -1.774 H35 A1I0M 81  
A1I0M H36 H36 H 0 1 N N N N N N 122.459 119.283 98.311  -5.255 1.085  -2.428 H36 A1I0M 82  
A1I0M H37 H37 H 0 1 N N N N N N 121.378 119.577 96.908  -4.142 0.387  -1.228 H37 A1I0M 83  
A1I0M H38 H38 H 0 1 N N N N N N 122.144 117.588 95.787  -5.909 -1.196 -0.509 H38 A1I0M 84  
A1I0M H39 H39 H 0 1 N N N N N N 123.015 117.020 97.252  -7.023 -0.499 -1.709 H39 A1I0M 85  
A1I0M H40 H40 H 0 1 N N N N N N 124.207 118.541 95.096  -5.408 -1.311 -3.574 H40 A1I0M 86  
A1I0M H41 H41 H 0 1 N N N N N N 123.857 119.617 98.738  -3.869 -3.753 -0.614 H41 A1I0M 87  
A1I0M H42 H42 H 0 1 N N N N N N 125.129 118.356 98.884  -4.689 -2.243 -0.152 H42 A1I0M 88  
A1I0M H43 H43 H 0 1 N N N N N N 126.807 120.326 96.961  -3.441 -3.591 -3.522 H43 A1I0M 89  
A1I0M H44 H44 H 0 1 N N N N N N 126.723 119.062 95.688  -4.615 -4.779 -2.905 H44 A1I0M 90  
A1I0M H45 H45 H 0 1 N N N N N N 125.819 120.600 95.486  -5.103 -3.615 -4.161 H45 A1I0M 91  
A1I0M H46 H46 H 0 1 N N N N N N 126.430 119.683 101.134 -5.024 -4.943 1.475  H46 A1I0M 92  
A1I0M H47 H47 H 0 1 N N N N N N 110.443 117.363 93.115  0.720  4.078  1.849  H47 A1I0M 93  
A1I0M H48 H48 H 0 1 N N N N N N 111.540 117.751 94.484  1.117  4.002  0.115  H48 A1I0M 94  
A1I0M H49 H49 H 0 1 N N N N N N 111.961 119.454 90.935  -0.280 5.330  -2.531 H49 A1I0M 95  
A1I0M H50 H50 H 0 1 N N N N N N 111.779 118.100 92.102  0.872  4.553  -1.418 H50 A1I0M 96  
A1I0M H51 H51 H 0 1 N N N N N N 117.633 117.608 96.170  -3.041 1.963  2.347  H51 A1I0M 97  
A1I0M H52 H52 H 0 1 N N N N N N 118.211 118.510 94.728  -2.542 1.870  0.641  H52 A1I0M 98  
A1I0M H53 H53 H 0 1 N N N N N N 118.605 117.756 98.361  -5.561 2.261  1.525  H53 A1I0M 99  
A1I0M H54 H54 H 0 1 N N N N N N 126.870 120.149 98.722  -6.889 -3.351 -0.435 H54 A1I0M 100 
A1I0M H55 H55 H 0 1 N N N N N N 125.561 121.379 98.691  -6.069 -4.861 -0.897 H55 A1I0M 101 
A1I0M H56 H56 H 0 1 N N N N N N 125.634 120.366 103.129 -6.016 -3.716 4.040  H56 A1I0M 102 
A1I0M H57 H57 H 0 1 N N N N N N 125.152 122.096 103.162 -7.667 -4.362 3.879  H57 A1I0M 103 
A1I0M H58 H58 H 0 1 N N N N N N 123.895 120.814 103.088 -6.267 -5.385 3.476  H58 A1I0M 104 
A1I0M H59 H59 H 0 1 N N N N N N 123.058 121.596 100.371 -7.962 -2.196 2.436  H59 A1I0M 105 
A1I0M H60 H60 H 0 1 N N N N N N 124.472 122.286 99.505  -7.416 -2.326 0.747  H60 A1I0M 106 
A1I0M H61 H61 H 0 1 N N N N N N 123.155 124.039 100.616 -9.818 -2.907 0.953  H61 A1I0M 107 
A1I0M H62 H62 H 0 1 N N N N N N 123.384 123.219 102.197 -8.862 -4.316 0.433  H62 A1I0M 108 
A1I0M H63 H63 H 0 1 N N N N N N 124.798 123.909 101.331 -9.408 -4.186 2.122  H63 A1I0M 109 
A1I0M H64 H64 H 0 1 N N N N N N 107.790 113.113 97.626  4.162  1.132  0.455  H64 A1I0M 110 
A1I0M H65 H65 H 0 1 N N N N N N 108.827 111.732 97.131  5.071  1.773  -0.935 H65 A1I0M 111 
A1I0M H66 H66 H 0 1 N N N N N N 108.258 115.532 96.687  4.000  4.155  -0.443 H66 A1I0M 112 
A1I0M H67 H67 H 0 1 N N N N N N 111.235 114.195 95.110  4.355  4.257  3.452  H67 A1I0M 113 
A1I0M H68 H68 H 0 1 N N N N N N 111.009 115.243 93.668  2.623  3.850  3.478  H68 A1I0M 114 
A1I0M H69 H69 H 0 1 N N N N N N 112.003 115.818 95.050  3.807  2.664  2.879  H69 A1I0M 115 
A1I0M H70 H70 H 0 1 N N N N N N 105.003 108.648 91.449  7.628  -6.370 -0.780 H70 A1I0M 116 
A1I0M H71 H71 H 0 1 N N N N N N 108.432 108.851 90.896  9.198  -3.806 -1.745 H71 A1I0M 117 
# 
loop_
_chem_comp_bond.comp_id 
_chem_comp_bond.atom_id_1 
_chem_comp_bond.atom_id_2 
_chem_comp_bond.value_order 
_chem_comp_bond.pdbx_aromatic_flag 
_chem_comp_bond.pdbx_stereo_config 
_chem_comp_bond.pdbx_ordinal 
A1I0M C19 C18 SING N N 1   
A1I0M C17 C18 DOUB N Z 2   
A1I0M C17 C16 SING N N 3   
A1I0M O4  P1  DOUB N N 4   
A1I0M C18 C20 SING N N 5   
A1I0M O3  P1  SING N N 6   
A1I0M C15 C16 SING N N 7   
A1I0M C15 C13 SING N N 8   
A1I0M O2  P1  SING N N 9   
A1I0M P1  O1  SING N N 10  
A1I0M C14 C13 SING N N 11  
A1I0M C20 C21 SING N N 12  
A1I0M C13 C12 DOUB N Z 13  
A1I0M C21 C22 SING N N 14  
A1I0M O1  C1  SING N N 15  
A1I0M C12 C11 SING N N 16  
A1I0M C11 C10 SING N N 17  
A1I0M C1  C2  SING N N 18  
A1I0M C9  C8  SING N N 19  
A1I0M C22 C23 DOUB N Z 20  
A1I0M C10 C8  SING N N 21  
A1I0M C8  C7  DOUB N E 22  
A1I0M C3  C2  SING N N 23  
A1I0M C3  C4  SING N N 24  
A1I0M C3  C5  SING N N 25  
A1I0M C25 C23 SING N N 26  
A1I0M C25 C26 SING N N 27  
A1I0M C23 C24 SING N N 28  
A1I0M C32 C31 SING N N 29  
A1I0M C32 C33 DOUB N Z 30  
A1I0M C34 C33 SING N N 31  
A1I0M C7  C6  SING N N 32  
A1I0M C6  C5  SING N N 33  
A1I0M C26 C27 SING N N 34  
A1I0M C31 C30 SING N N 35  
A1I0M C33 C35 SING N N 36  
A1I0M C30 C28 SING N N 37  
A1I0M C27 C28 DOUB N Z 38  
A1I0M C28 C29 SING N N 39  
A1I0M C35 C36 SING N N 40  
A1I0M C36 C37 SING N N 41  
A1I0M C40 C41 SING N N 42  
A1I0M C40 C38 SING N N 43  
A1I0M C37 C38 DOUB N Z 44  
A1I0M C38 C39 SING N N 45  
A1I0M C6  H1  SING N N 46  
A1I0M C6  H2  SING N N 47  
A1I0M C4  H3  SING N N 48  
A1I0M C4  H4  SING N N 49  
A1I0M C4  H5  SING N N 50  
A1I0M C3  H6  SING N N 51  
A1I0M C2  H7  SING N N 52  
A1I0M C2  H8  SING N N 53  
A1I0M C1  H9  SING N N 54  
A1I0M C1  H10 SING N N 55  
A1I0M C12 H11 SING N N 56  
A1I0M C10 H12 SING N N 57  
A1I0M C10 H13 SING N N 58  
A1I0M C14 H14 SING N N 59  
A1I0M C14 H15 SING N N 60  
A1I0M C14 H16 SING N N 61  
A1I0M C16 H17 SING N N 62  
A1I0M C16 H18 SING N N 63  
A1I0M C17 H19 SING N N 64  
A1I0M C19 H20 SING N N 65  
A1I0M C19 H21 SING N N 66  
A1I0M C19 H22 SING N N 67  
A1I0M C20 H23 SING N N 68  
A1I0M C20 H24 SING N N 69  
A1I0M C21 H25 SING N N 70  
A1I0M C21 H26 SING N N 71  
A1I0M C22 H27 SING N N 72  
A1I0M C24 H28 SING N N 73  
A1I0M C24 H29 SING N N 74  
A1I0M C24 H30 SING N N 75  
A1I0M C26 H31 SING N N 76  
A1I0M C26 H32 SING N N 77  
A1I0M C29 H33 SING N N 78  
A1I0M C29 H34 SING N N 79  
A1I0M C29 H35 SING N N 80  
A1I0M C30 H36 SING N N 81  
A1I0M C30 H37 SING N N 82  
A1I0M C31 H38 SING N N 83  
A1I0M C31 H39 SING N N 84  
A1I0M C32 H40 SING N N 85  
A1I0M C35 H41 SING N N 86  
A1I0M C35 H42 SING N N 87  
A1I0M C34 H43 SING N N 88  
A1I0M C34 H44 SING N N 89  
A1I0M C34 H45 SING N N 90  
A1I0M C37 H46 SING N N 91  
A1I0M C11 H47 SING N N 92  
A1I0M C11 H48 SING N N 93  
A1I0M C15 H49 SING N N 94  
A1I0M C15 H50 SING N N 95  
A1I0M C25 H51 SING N N 96  
A1I0M C25 H52 SING N N 97  
A1I0M C27 H53 SING N N 98  
A1I0M C36 H54 SING N N 99  
A1I0M C36 H55 SING N N 100 
A1I0M C39 H56 SING N N 101 
A1I0M C39 H57 SING N N 102 
A1I0M C39 H58 SING N N 103 
A1I0M C40 H59 SING N N 104 
A1I0M C40 H60 SING N N 105 
A1I0M C41 H61 SING N N 106 
A1I0M C41 H62 SING N N 107 
A1I0M C41 H63 SING N N 108 
A1I0M C5  H64 SING N N 109 
A1I0M C5  H65 SING N N 110 
A1I0M C7  H66 SING N N 111 
A1I0M C9  H67 SING N N 112 
A1I0M C9  H68 SING N N 113 
A1I0M C9  H69 SING N N 114 
A1I0M O2  H70 SING N N 115 
A1I0M O3  H71 SING N N 116 
# 
loop_
_pdbx_chem_comp_descriptor.comp_id 
_pdbx_chem_comp_descriptor.type 
_pdbx_chem_comp_descriptor.program 
_pdbx_chem_comp_descriptor.program_version 
_pdbx_chem_comp_descriptor.descriptor 
A1I0M InChI            InChI                1.06  "InChI=1S/C41H71O4P/c1-10-34(2)18-11-19-35(3)20-12-21-36(4)22-13-23-37(5)24-14-25-38(6)26-15-27-39(7)28-16-29-40(8)30-17-31-41(9)32-33-45-46(42,43)44/h18,20,22,24,26,28,30,41H,10-17,19,21,23,25,27,29,31-33H2,1-9H3,(H2,42,43,44)/b34-18-,35-20-,36-22-,37-24-,38-26-,39-28-,40-30+/t41-/m0/s1" 
A1I0M InChIKey         InChI                1.06  CMOQFVWDXXQTMI-PJJFLQJDSA-N                                                                                                                                                                                                                                                                       
A1I0M SMILES_CANONICAL CACTVS               3.385 "CCC(\C)=C/CC\C(C)=C/CCC(\C)=C/CCC(\C)=C/CCC(\C)=C/CCC(/C)=C\CC\C(C)=C\CC[C@H](C)CCO[P](O)(O)=O"                                                                                                                                                                                                  
A1I0M SMILES           CACTVS               3.385 "CCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCC[CH](C)CCO[P](O)(O)=O"                                                                                                                                                                                                                 
A1I0M SMILES_CANONICAL "OpenEye OEToolkits" 2.0.7 "CC/C(=C\CC/C(=C\CC/C(=C\CC/C(=C\CC/C(=C\CC/C(=C\CC/C(=C/CC[C@H](C)CCOP(=O)(O)O)/C)/C)/C)/C)/C)/C)/C"                                                                                                                                                                                             
A1I0M SMILES           "OpenEye OEToolkits" 2.0.7 "CCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(C)CCOP(=O)(O)O)C)C)C)C)C)C)C"                                                                                                                                                                                                                      
# 
_pdbx_chem_comp_identifier.comp_id           A1I0M 
_pdbx_chem_comp_identifier.type              "SYSTEMATIC NAME" 
_pdbx_chem_comp_identifier.program           "OpenEye OEToolkits" 
_pdbx_chem_comp_identifier.program_version   2.0.7 
_pdbx_chem_comp_identifier.identifier        "[(3~{S},6~{E},10~{Z},14~{Z},18~{Z},22~{Z},26~{Z},30~{Z})-3,7,11,15,19,23,27,31-octamethyltritriaconta-6,10,14,18,22,26,30-heptaenyl] dihydrogen phosphate" 
# 
_pdbx_chem_comp_synonyms.ordinal      1 
_pdbx_chem_comp_synonyms.comp_id      A1I0M 
_pdbx_chem_comp_synonyms.name         "[(3S,6E,10Z,14Z,18Z,22Z,26Z,30Z)-3,7,11,15,19,23,27,31-octamethyltritriaconta-6,10,14,18,22,26,30-heptaenyl] dihydrogen phosphate" 
_pdbx_chem_comp_synonyms.provenance   PDB 
_pdbx_chem_comp_synonyms.type         ? 
# 
loop_
_pdbx_chem_comp_audit.comp_id 
_pdbx_chem_comp_audit.action_type 
_pdbx_chem_comp_audit.date 
_pdbx_chem_comp_audit.processing_site 
A1I0M "Create component" 2025-01-30 PDBE 
A1I0M "Initial release"  2025-12-24 RCSB 
# 
